Bromide

Bromide

SCHEMBL7401678

Br.O=C(O)CCN1CSc2ccccc21

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.37
KMT2A Q03164 5/20 0.54
MEN1 O00255 4/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 5/20 0.51
KDM4E B2RXH2 4/20 0.51
TDP1 Q9NUW8 2/20 0.51
POLB P06746 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
TP53 P04637 1/20 0.41
MME P08473 1/20 0.40
ACE P12821 1/20 0.40
FABP3 P05413 1/20 0.39
FABP4 P15090 1/20 0.39
FABP5 Q01469 1/20 0.39
ALDH1A1 P00352 2/20 0.39
NOTUM Q6P988 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Bromide SCHEMBL31588381 1.00 KMT2A (0.54) KMT2AMEN1LMNAMAPTKDM4E
Bromide SCHEMBL887867 0.90 MEN1 (0.47) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL27742954 0.88 MEN1 (0.48) KMT2AMEN1LMNAMAPTKDM4E
Bromide SCHEMBL27458290 0.84 MAPT (0.46) KMT2AMEN1LMNAMAPTKDM4E
Bromide SCHEMBL2951034 0.84 MAPT (0.46) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL5940974 0.82 MAPT (0.47) KMT2AMEN1LMNAMAPTKDM4E
Bromide SCHEMBL31588243 0.80 TP53 (0.36) KMT2AMEN1LMNAMAPTKDM4E
Bromide SCHEMBL27893556 0.77 ALDH1A1 (0.48) KMT2AMEN1LMNAMAPTKDM4E
Bromide SCHEMBL2954116 0.77 ALDH1A1 (0.48) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL6289192 0.76 RBP4 (0.43) KMT2AMEN1LMNAMAPTKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748464-B1 SENSITIZERS FOR PHOTOTHERMOGRAPHIC ELEMENTS IMATION CORP A DELAWARE CORP (US) 1998-06-24 EP disclosed
EP-0808163-A2 USE OF THIAZOLIUM COMPOUNDS FOR PREVENTING AND REVERSING THE FORMATION OF ADVANCED GLYCOSYLATION ENDPRODUCTS ALTEON, INC. (US) 1997-11-26 EP disclosed
EP-0748464-A1 SENSITIZERS FOR PHOTOTHERMOGRAPHIC ELEMENTS Imation Corp (a Delaware Corporation) (US) 1996-12-18 EP disclosed
WO-1996022095-A2 USE OF THIAZOLIUM COMPOUNDS FOR PREVENTING AND REVERSING THE FORMATION OF ADVANCED GLYCOSYLATION ENDPRODUCTS ALTEON INC. (US) 1996-07-25 WO disclosed
WO-1995023355-A1 SENSITIZERS FOR PHOTOTHERMOGRAPHIC ELEMENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-08-31 WO disclosed
US-5441866-A Benzothiazole-type cyanine dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-08-15 US disclosed